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Home> Encyclopedia > Hot Product Listed 6   > 6H-Purine-6-thione,1,7-dihydro-7-methyl-
5654-86-4 structure

6H-Purine-6-thione,1,7-dihydro-7-methyl-

Iupac Name:3-(2-methylpropyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
CAS No.:5654-86-4
Molecular Weight:210.277
Molecular Formula:C6H5CLN4O (isomer)
Properties
Density
1.33
Boiling Point
402.2°C at 760 mmHg
Flash Point
158.1°C
Computational chemical data
  • Molecular Weight:210.277g/mol
  • Molecular Formula:C6H5CLN4O
  • Compound Is Canonicalized:True
  • Exact Mass:210.137
  • Monoisotopic Mass:210.137
  • Complexity:288
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:49.4A^2
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:2
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBzMAAAAAAAAAAAAAAAAAAAAWAAAAAsAAAAAAAAAFgAAAAAHgAQAAAADSjBgAQCAAPAAAAI AAEQEAAAAAAAAAAAAIGIAAAAQBIAgCAUAAAAFgCAAAAYAQAMAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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  • Tel:+86-571-85134551
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